SCHEMBL5335613

SCHEMBL5335613

Fc1ccc(-c2cnc(Nc3ccc4[nH]ncc4c3)o2)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 2/20 0.58
ALOX5 P09917 1/20 0.54
KDR P35968 3/20 0.54
MKNK1 Q9BUB5 3/20 0.53
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
IMPDH2 P12268 2/20 0.47
TNIK Q9UKE5 2/20 0.45
TRPV1 Q8NER1 1/20 0.45
MAOB P27338 1/20 0.45
MAPKAPK2 P49137 1/20 0.44
FLT1 P17948 1/20 0.44
FLT4 P35916 1/20 0.44
ROCK2 O75116 1/20 0.44
ROCK1 Q13464 1/20 0.44
VCP P55072 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5333863 0.88 VCP (0.58) CDC7ALOX5KDRMKNK1IMPDH2
SCHEMBL5336433 0.88 MKNK1 (0.51) CDC7KDRMKNK1RAB9AIMPDH2
SCHEMBL5343891 0.88 VCP (0.58) CDC7KDRMKNK1IMPDH2TNIK
SCHEMBL5316809 0.88 NOS1 (0.48) CDC7KDRMKNK1IMPDH2TNIK
SCHEMBL5336680 0.88 IMPDH2 (0.59) KDRIMPDH2FLT1FLT4ROCK1
SCHEMBL5333205 0.88 IMPDH2 (0.53) CDC7ALOX5KDRMKNK1IMPDH2
SCHEMBL14465941 0.88 IMPDH2 (0.61) KDRIMPDH2FLT1FLT4ROCK1
SCHEMBL5337614 0.87 PIK3CA (0.54) CDC7KDRMKNK1NPC1RAB9A
SCHEMBL14466977 0.87 TRPV1 (0.61) CDC7KDRMKNK1IMPDH2TRPV1
SCHEMBL5374741 0.85 FLT1 (0.54) CDC7KDRMKNK1IMPDH2TNIK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO claimed
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO disclosed
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO disclosed